Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ammonia | HCID 222 | — |
| Reactant | 1-Butanol | HCID 263 | — |
| Reactant | Dimethyl Sulfoxide | HCID 679 | — |
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | 3-Amino-1,1,1-trifluoropropan-2-ol | HCID 418965 | — |
| Reactant | 2-(Trifluoromethyl)oxirane | HCID 520769 | — |
| Reactant | 2-fluoro-9-isopropyl-N-(pyridin-3-ylmethyl)-9H-purin-6-amine | HCID 11522060 | — |
| Product | HCID 57433125 | HCID 57433125 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
| ORD ID | ord-846709af69114a019197acca43154837 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
